input word = C00051671

Metabolite InformationStructural formula
Name Murrangatin acetate
Formula C19H22O6
Mw 346.14163844
CAS RN 166197-38-2
C_ID C00051671
InChIKey XLKNGGICMFORNP-ZSFWTHPBNA-N
InChICode InChI=1S/C19H22O6/c1-6-23-17(11(2)3)19(24-12(4)20)16-14(22-5)9-7-13-8-10-15(21)25-18(13)16/h7-10,17,19H,2,6H2,1,3-5H3/t17-,19+/m1/s1
SMILES C=C(C)[C@@H](OCC)[C@@H](OC(C)=O)c1c(OC)ccc2ccc(=O)oc12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaeMurraya paniculata Ref.
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